<html><head></head><body><div style="font-family:Helvetica Neue, Helvetica, Arial, sans-serif;font-size:16px;"><div><br></div><div><span>>You can add the -debug 1 option to get a lot of, largely <br></span></div><div><span>>unintelligible,
information printed to gmx.debug. -debug 2 <br></span></div><div><span>>will print even more, per
atom, information.</span></div><div><br></div><div><br></div><div><br></div><div>So, I ran <br></div><div style="font-family:Helvetica Neue, Helvetica, Arial, sans-serif;font-size:16px;"><div><div><br></div><div><span>gmx mdrun -debug 2 -nb gpu -ntmpi 1 -ntomp 16 -v -deffnm nvt</span></div><div><span><br></span></div><div><span>However, the information printed in the terminal and the log file are the same as before.</span></div><div><span><br></span></div><div><span></span><br></div><div><br></div><div class="ydp72567332signature">Regards,<br>Mahmood</div></div>
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